{ "property-id" "tag:staff@noreply.openkim.org,2014-04-15:property/configuration-cluster-relaxed" "instance-id" 1 "species" { "source-value" [ "Si" "Si" "Si" "Si" "Si" "Si" "Si" ] } "unrelaxed-configuration-positions" { "source-value" [ [ 2.836172 2.264881 3.605889 ] [ 1.711544 3.356754 1.507539 ] [ 2.817956 4.908146 3.003841 ] [ 0.8092812 3.284881 3.852119 ] [ 4.796821 1.314646 2.655969 ] [ 4.297416 3.615744 1.848977 ] [ 4.570903 3.768738 4.135906 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 2.836172e-10 2.264881e-10 3.605889e-10 ] [ 1.711544e-10 3.356754e-10 1.507539e-10 ] [ 2.817956e-10 4.908146e-10 3.003841e-10 ] [ 8.092812000000001e-11 3.284881e-10 3.852119e-10 ] [ 4.796821e-10 1.314646e-10 2.655969e-10 ] [ 4.297416000000001e-10 3.615744e-10 1.848977e-10 ] [ 4.570903000000001e-10 3.768738e-10 4.135906000000001e-10 ] ] } "unrelaxed-configuration-forces" { "source-value" [ [ -8.6950467 -31.9472591 21.5326496 ] [ -12.1843173 -1.3438579 -18.0686621 ] [ -4.1271447 32.3676839 0.9190878 ] [ -12.2843283 -0.9603745 7.1721256 ] [ 6.1477359 -13.5472645 -5.1815528 ] [ 19.3427377 6.5263011 -25.2556241 ] [ 11.8003633 8.9047711 18.8819759 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ -1.393100053950419e-08 -5.118515162866005e-08 3.449910777299847e-08 ] [ -1.952142831846898e-08 -2.153097709057384e-09 -2.894918798575503e-08 ] [ -6.612414748998629e-09 5.185874641402457e-08 1.472540985622506e-09 ] [ -1.968166360449181e-08 -1.53868957111249e-09 1.149101195776117e-08 ] [ 9.849758729832848e-09 -2.17051104576938e-08 -8.301762755600779e-09 ] [ 3.099048212520677e-08 1.045628704272132e-08 -4.046397047673304e-08 ] [ 1.890626619620634e-08 1.42670160699955e-08 3.025226034148904e-08 ] ] } "unrelaxed-potential-energy" { "source-value" 14.676402 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" 2.351418816186236e-18 } "relaxed-configuration-positions" { "source-value" [ [ 3.2874189 2.1466442 4.198744 ] [ 1.8810095 3.5295467 0.8876052 ] [ 2.4373603 5.4873233 4.2269781 ] [ 1.5051634 3.4777592 3.2080753 ] [ 4.6839416 1.4361525 2.4456212 ] [ 3.8230928 2.2820205 0.4241852 ] [ 4.2221067 4.1543435 5.219031 ] ] "source-unit" "angstrom" "si-unit" "m" "si-value" [ [ 3.2874189e-10 2.1466442e-10 4.198744e-10 ] [ 1.8810095e-10 3.5295467e-10 8.876052e-11 ] [ 2.4373603e-10 5.4873233e-10 4.2269781e-10 ] [ 1.5051634e-10 3.4777592e-10 3.2080753e-10 ] [ 4.6839416e-10 1.4361525e-10 2.4456212e-10 ] [ 3.8230928e-10 2.2820205e-10 4.241852e-11 ] [ 4.222106700000001e-10 4.154343500000001e-10 5.219031000000001e-10 ] ] } "relaxed-configuration-forces" { "source-value" [ [ 6.7e-06 2.26e-05 7.4e-06 ] [ 3.3e-06 4.05e-05 3.2e-05 ] [ 4.61e-05 -9.05e-05 -2.25e-05 ] [ 1e-06 -1.6e-05 -3.46e-05 ] [ 9e-07 1.44e-05 2.63e-05 ] [ -2.64e-05 8.4e-06 2.32e-05 ] [ -3.16e-05 2.06e-05 -3.19e-05 ] ] "source-unit" "eV/angstrom" "si-unit" "kg m / s^2" "si-value" [ [ 1.073458335936e-14 3.620919163008e-14 1.185610699392e-14 ] [ 5.28718284864e-15 6.488815314240001e-14 5.12696518656e-14 ] [ 7.386034221888001e-14 -1.449969841824e-13 -3.604897396800001e-14 ] [ 1.6021766208e-15 -2.56348259328e-14 -5.543531107968001e-14 ] [ 1.44195895872e-15 2.307134333952e-14 4.213724512704e-14 ] [ -4.229746278912e-14 1.345828361472e-14 3.717049760256e-14 ] [ -5.062878121728e-14 3.300483838848e-14 -5.110943420352001e-14 ] ] } "relaxed-potential-energy" { "source-value" -16.254682 "source-unit" "eV" "si-unit" "kg m^2 / s^2" "si-value" -2.604287147893859e-18 } }